3-(7-chloranyl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanoate

Systemtic Name: 3-(7-chloranyl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanoate Openeye Name: 3-(7-chloro-4-oxo-2-thioxo-1H-quinazolin-3-yl)propanoate CAS Name: 3-(7-chloro-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanoate IUPAC Name: 3-(7-chloro-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanoate Traditional Name: 3-(7-chloro-4-keto-2-thioxo-1H-quinazolin-3-yl)propionate Formula: C11H8ClN2O3S- MolecularWeight: 283.71082

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)NC(=S)N(C2=O)CCC(=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1Cl)NC(=S)N(C2=O)CCC(=O)[O-]

InChI

InChI=1S/C11H9ClN2O3S/c12-6-1-2-7-8(5-6)13-11(18)14(10(7)17)4-3-9(15)16/h1-2,5H,3-4H2,(H,13,18)(H,15,16)/p-1